1-(3,4-dimethylphenyl)-3-[(4-ethoxy-5-methoxy-2-nitro-phenyl)carbonylamino]thiourea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[(4-ethoxy-5-methoxy-2-nitro-phenyl)carbonylamino]thiourea Openeye Name: 1-(3,4-dimethylphenyl)-3-[(4-ethoxy-5-methoxy-2-nitro-benzoyl)amino]thiourea CAS Name: 1-(3,4-dimethylphenyl)-3-[[(4-ethoxy-5-methoxy-2-nitrophenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[(4-ethoxy-5-methoxy-2-nitrobenzoyl)amino]thiourea Traditional Name: 1-(3,4-dimethylphenyl)-3-[(4-ethoxy-5-methoxy-2-nitro-benzoyl)amino]thiourea Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NNC(=S)NC2=CC(=C(C=C2)C)C)OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NNC(=S)NC2=CC(=C(C=C2)C)C)OC

InChI

InChI=1S/C19H22N4O5S/c1-5-28-17-10-15(23(25)26)14(9-16(17)27-4)18(24)21-22-19(29)20-13-7-6-11(2)12(3)8-13/h6-10H,5H2,1-4H3,(H,21,24)(H2,20,22,29)